ethyl (E)-2-[2-(4-methoxyphenyl)ethynyl]-2-methyl-6-oxidanyl-hex-4-enoate

Systemtic Name: ethyl (E)-2-[2-(4-methoxyphenyl)ethynyl]-2-methyl-6-oxidanyl-hex-4-enoate Openeye Name: ethyl (E)-6-hydroxy-2-[2-(4-methoxyphenyl)ethynyl]-2-methyl-hex-4-enoate CAS Name: (E)-6-hydroxy-2-[2-(4-methoxyphenyl)ethynyl]-2-methyl-4-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-6-hydroxy-2-[2-(4-methoxyphenyl)ethynyl]-2-methylhex-4-enoate Traditional Name: (E)-6-hydroxy-2-[2-(4-methoxyphenyl)ethynyl]-2-methyl-hex-4-enoic acid ethyl ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC=CCO)C#CC1=CC=C(C=C1)OC

Isomeric SMILES

CCOC(=O)C(C)(C/C=C/CO)C#CC1=CC=C(C=C1)OC

InChI

InChI=1S/C18H22O4/c1-4-22-17(20)18(2,12-5-6-14-19)13-11-15-7-9-16(21-3)10-8-15/h5-10,19H,4,12,14H2,1-3H3/b6-5+